HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 408836Generated: October 25, 2026
Methanol → 1-(4-Bromophenyl)-9-methyl-2-(2,3,4-trifluorophenoxy)-1,9-dihydro-6H-purin-6-one
https://huagongshe.com/reaction/408836
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Methanol | HCID 887 | — |
| Reactant | 2,3,4-Trifluorophenol | HCID 123174 | — |
| Reactant | 1-(4-Bromophenyl)-2-chloro-9-methyl-1,9-dihydro-6H-purin-6-one | HCID 57614152 | — |
| Solvent | Dichloromethane | HCID 6344 | — |
| Product | 1-(4-Bromophenyl)-9-methyl-2-(2,3,4-trifluorophenoxy)-1,9-dihydro-6H-purin-6-one | HCID 24744032 | — |
Reaction Steps
1-(4-Bromophenyl)-2-chloro-9-methyl-1,9-dihydro-6H-purin-6-one (150 mg, 0.4417 mmol) and 2,3,4-trifluorophenol (130.8 mg, 0.8834 mmol) are added to a vial, and the sealed mixture is heated with stirring at 140° C. for 23 h. Silica gel column chromatography (MeOH:CH2Cl2=0.5:99.5) gives the title compound as a white solid. 1H NMR (400 MHz, CDCl3) 7.66 (3H, m), 7.24 (2H, m), 7.00 (2H, m), 3.58 (3H, s). MS (M+1): 451.08; RT=1.31 min. The IC50 determined as described in Example 6 is 100 nanomolar or less.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08759361B2 |
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| Source dataset | uspto-grants-2014_06 |
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| ORD ID | ord-dd9828272f7349498ffe3bde326c78ab |
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| Source note | uspto-grants-2014_06 |
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